⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL2428485 | 0.75 | — | — | |
| SCHEMBL380024 | 0.71 | — | — | |
| SCHEMBL23921189 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL28424367 | 0.69 | — | — | |
| SCHEMBL11227409 | 0.69 | — | — | |
| SCHEMBL23153103 | 0.67 | CA12 (0.44) | — | |
| SCHEMBL21409564 | 0.65 | ACE (0.39) | — | |
| Acetic Acid SCHEMBL2433618 | 0.65 | ALDH1A1 (0.38) | — | |
| SCHEMBL1106411 | 0.65 | — | — | |
| SCHEMBL284258 | 0.65 | — | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230242568-A1 | POLYMER LINKED MULTIMERS OF GUANOSINE-3', 5'-CYCLIC MONOPHOSPHATES | MIRECA MEDICINES GMBH (DE) | 2023-08-03 | — | — | US | disclosed |